3-tert-butyl-1-(phenylmethyl)pyrazole-4-carbaldehyde

Systemtic Name: 3-tert-butyl-1-(phenylmethyl)pyrazole-4-carbaldehyde Openeye Name: 1-benzyl-3-tert-butyl-pyrazole-4-carbaldehyde CAS Name: 3-tert-butyl-1-(phenylmethyl)-4-pyrazolecarboxaldehyde IUPAC Name: 1-benzyl-3-tert-butylpyrazole-4-carbaldehyde Traditional Name: 1-benzyl-3-tert-butyl-pyrazole-4-carbaldehyde Formula: C15H18N2O MolecularWeight: 242.31622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1C=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=NN(C=C1C=O)CC2=CC=CC=C2

InChI

InChI=1S/C15H18N2O/c1-15(2,3)14-13(11-18)10-17(16-14)9-12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3